JOURNAL OF PHARMACEUTICAL RESEARCH INTERNATIONAL, vol.32, no.48, pp.16-30, 2020 (Journal Indexed in ESCI)
Article / Article
Title of Journal :
JOURNAL OF PHARMACEUTICAL RESEARCH INTERNATIONAL
Bioactive molecule design, virtual screening, docking, virtual library, drug design, drug discovery, DRUG DISCOVERY, DATABASE, DESIGN, COMBINATORIAL, PREDICTION, POWERFUL, LIGANDS, DOCKING
Objective: Tocreate an easy- to-use structure-based screening workflow using KNIME and open source software to prepare and screen virtual libraries in order to discover novel bioactive or drug molecules.